Information card for entry 4502415

Structure parameters

• Common name: ‘Aluminium-Borate’
• Formula: C5 H20 Al B5 N2 O12
• Calculated formula: C5 H16 Al B5 N2 O12
• Title of publication: Amine-Templated Aluminoborates Exhibiting Graphite and Diamond Nets
• Authors of publication: Paul, Avijit Kumar; Natarajan, Srinivasan
• Journal of publication: Crystal Growth & Design
• Year of publication: 2010
• Journal volume: 10
• Journal issue: 2
• Pages of publication: 765
• a: 9.102 ± 0.005 Å
• b: 10.402 ± 0.005 Å
• c: 9.283 ± 0.005 Å
• α: 90 ± 0.005°
• β: 110.941 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 820.9 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.1227
• Residual factor for significantly intense reflections: 0.0741
• Weighted residual factors for significantly intense reflections: 0.1462
• Weighted residual factors for all reflections included in the refinement: 0.165
• Goodness-of-fit parameter for all reflections included in the refinement: 0.939
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No